#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mbg n PRO 96 N -0.50 2.10 -1.83 0.00 -0.02 -1.26 -4.86 135.00 128.63 3mbg n PRO 96 Ca -0.07 0.76 -0.41 0.00 -2.02 0.00 0.00 63.50 61.75 3mbg n PRO 96 Cb 0.54 -2.50 -0.01 0.00 -0.02 0.00 0.00 33.50 31.51 3mbg n PRO 96 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 3mbg s PRO 97 N 0.68 4.14 1.06 0.52 0.05 -1.26 -5.01 135.00 135.19 3mbg s PRO 97 Ca 0.77 2.53 -0.18 0.00 0.05 0.00 0.00 61.00 64.17 3mbg s PRO 97 Cb -0.68 -3.00 0.24 0.00 0.05 0.00 0.00 34.50 31.11 3mbg s PRO 97 CO 0.40 -0.53 1.27 0.16 0.05 0.00 0.00 177.00 178.35 3mbg s ASP 98 N 0.06 2.18 0.29 6.66 1.47 -1.26 -4.62 116.67 121.45 3mbg s ASP 98 Ca 0.56 0.32 0.04 0.00 1.18 0.00 0.00 52.55 54.65 3mbg s ASP 98 Cb -0.46 -0.36 0.73 0.00 -0.34 0.00 0.00 42.92 42.48 3mbg s ASP 98 CO 0.56 -3.31 1.72 -0.09 0.68 0.00 0.00 175.17 174.73 3mbg h ARG 99 N -2.04 0.49 -0.10 2.11 2.43 -1.98 -0.43 114.38 114.86 3mbg h ARG 99 Ca -0.44 -0.03 -0.08 0.00 -0.81 0.00 0.00 59.98 58.62 3mbg h ARG 99 Cb 1.24 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 30.68 3mbg h ARG 99 CO 0.33 0.32 -0.27 0.93 -1.51 0.00 0.00 179.97 179.78 3mbg h GLU 100 N 0.50 0.35 -0.24 0.20 4.39 -1.99 -1.08 114.58 116.72 3mbg h GLU 100 Ca 0.56 -0.25 -0.08 0.00 0.34 0.00 0.00 59.36 59.93 3mbg h GLU 100 Cb 1.01 0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.69 3mbg h GLU 100 CO -0.48 0.86 -0.16 1.49 -1.16 0.00 0.00 179.01 179.57 3mbg h GLU 101 N -0.10 0.53 -0.58 2.33 4.81 -1.83 -1.49 114.58 118.25 3mbg h GLU 101 Ca -0.01 -0.25 -0.00 0.00 -0.13 0.00 0.00 59.36 58.97 3mbg h GLU 101 Cb 0.88 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 30.23 3mbg h GLU 101 CO 0.06 0.82 0.35 1.25 -0.73 0.00 0.00 179.01 180.76 3mbg h LEU 102 N 0.24 0.70 0.10 1.64 5.85 -1.15 -1.96 115.31 120.73 3mbg h LEU 102 Ca 0.05 -0.06 -0.00 0.00 0.84 0.00 0.00 57.88 58.71 3mbg h LEU 102 Cb 0.68 -0.18 -0.00 0.00 0.37 0.00 0.00 40.66 41.53 3mbg h LEU 102 CO 0.04 0.55 -0.06 1.23 -0.34 0.00 0.00 178.44 179.86 3mbg h GLY 103 N 0.79 -0.16 0.61 3.75 0.00 -1.04 0.54 103.07 107.56 3mbg h GLY 103 Ca 0.21 0.07 0.06 0.00 0.00 0.00 0.00 47.33 47.66 3mbg h GLY 103 CO -0.04 -0.07 0.18 3.21 0.00 0.00 0.00 176.54 179.82 3mbg h ARG 104 N -0.16 0.35 -0.30 4.80 3.08 -1.21 -0.81 114.38 120.13 3mbg h ARG 104 Ca -0.01 -0.02 -0.10 0.00 0.07 0.00 0.00 59.98 59.92 3mbg h ARG 104 Cb 0.13 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.09 3mbg h ARG 104 CO 0.01 0.23 -0.24 0.45 -1.07 0.00 0.00 179.97 179.35 3mbg h HIS 105 N 0.36 0.66 -0.31 3.04 3.86 -1.14 -0.54 115.15 121.08 3mbg h HIS 105 Ca 0.21 -0.14 -0.04 0.00 -1.16 0.00 0.00 60.37 59.25 3mbg h HIS 105 Cb 0.20 -0.16 -0.01 0.00 1.06 0.00 0.00 27.41 28.50 3mbg h HIS 105 CO -0.15 0.78 0.06 0.77 0.86 0.00 0.00 177.93 180.25 3mbg h SER 106 N 0.51 0.49 -0.74 2.45 0.02 -0.29 -0.71 113.55 115.28 3mbg h SER 106 Ca 0.07 -0.25 -0.06 0.00 -0.84 0.00 0.00 61.79 60.71 3mbg h SER 106 Cb 0.69 -0.13 -0.03 0.00 0.14 0.00 0.00 62.40 63.07 3mbg h SER 106 CO 0.05 0.62 0.22 -0.50 -1.14 0.00 0.00 176.83 176.08 3mbg h TRP 107 N 0.34 1.21 -0.45 3.45 4.06 -0.99 -0.86 115.95 122.72 3mbg h TRP 107 Ca 0.10 -0.13 0.04 0.00 2.06 0.00 0.00 58.89 60.96 3mbg h TRP 107 Cb 0.33 -0.35 -0.04 0.00 -1.00 0.00 0.00 29.16 28.10 3mbg h TRP 107 CO 0.02 0.96 0.21 0.00 -3.56 0.00 0.00 178.44 176.07 3mbg h ALA 108 N 1.12 0.56 0.04 1.49 0.00 -0.80 0.14 119.26 121.82 3mbg h ALA 108 Ca 0.24 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.17 3mbg h ALA 108 Cb 0.32 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.07 3mbg h ALA 108 CO -0.01 -0.15 -0.02 0.28 0.00 0.00 0.00 179.25 179.36 3mbg h VAL 109 N 0.43 1.02 -0.13 0.00 2.07 -0.76 -1.64 116.25 117.25 3mbg h VAL 109 Ca 0.20 -0.19 -0.01 0.00 0.82 0.00 0.00 66.70 67.52 3mbg h VAL 109 Cb 0.13 1.15 -0.01 0.00 -1.52 0.00 0.00 31.29 31.04 3mbg h VAL 109 CO -0.15 0.05 0.05 -0.07 0.02 0.00 0.00 177.57 177.47 3mbg h LEU 110 N -0.13 0.17 -1.25 2.57 3.38 -0.83 -0.76 115.31 118.45 3mbg h LEU 110 Ca -0.01 -0.16 -0.07 0.00 0.09 0.00 0.00 57.88 57.74 3mbg h LEU 110 Cb 0.12 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 3mbg h LEU 110 CO 0.01 0.28 -0.27 0.45 0.09 0.00 0.00 178.44 179.00 3mbg h HIS 111 N 0.05 0.18 -0.14 1.13 3.86 -0.76 -1.24 115.15 118.24 3mbg h HIS 111 Ca 0.04 -0.03 -0.16 0.00 -1.16 0.00 0.00 60.37 59.06 3mbg h HIS 111 Cb 0.16 -0.05 0.01 0.00 1.06 0.00 0.00 27.41 28.59 3mbg h HIS 111 CO -0.02 0.43 -0.55 1.15 0.86 0.00 0.00 177.93 179.80 3mbg h THR 112 N 0.15 1.33 -0.87 2.45 2.02 -1.06 0.30 112.91 117.23 3mbg h THR 112 Ca 0.02 -1.82 0.03 0.00 0.77 0.00 0.00 66.41 65.42 3mbg h THR 112 Cb 0.56 2.06 -0.05 0.00 -1.74 0.00 0.00 68.15 68.98 3mbg h THR 112 CO 0.04 0.56 0.56 -0.07 0.37 0.00 0.00 175.52 176.98 3mbg h LEU 113 N 0.28 0.94 -0.50 2.58 4.07 -0.95 -2.24 115.31 119.48 3mbg h LEU 113 Ca -0.03 -0.01 -0.06 0.00 0.08 0.00 0.00 57.88 57.86 3mbg h LEU 113 Cb 1.18 -0.21 -0.02 0.00 1.08 0.00 0.00 40.66 42.69 3mbg h LEU 113 CO 0.12 0.65 0.08 0.00 -1.08 0.00 0.00 178.44 178.20 3mbg h ALA 114 N 1.36 0.67 0.00 1.53 0.00 -1.16 -2.22 119.26 119.43 3mbg h ALA 114 Ca 0.34 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 3mbg h ALA 114 Cb -0.01 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.59 3mbg h ALA 114 CO -0.11 0.40 -0.06 0.00 0.00 0.00 0.00 179.25 179.48 3mbg h ALA 115 N 0.97 1.67 -0.21 0.00 0.00 -0.34 -2.63 119.26 118.72 3mbg h ALA 115 Ca 0.15 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.01 3mbg h ALA 115 Cb 0.40 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.18 3mbg h ALA 115 CO 0.01 0.08 0.00 0.66 0.00 0.00 0.00 179.25 180.00 3mbg n TYR 116 N -4.14 0.27 -1.97 0.00 4.01 -1.02 -4.98 117.16 109.33 3mbg n TYR 116 Ca -0.03 -0.22 -0.37 0.00 -0.16 0.00 0.00 57.90 57.12 3mbg n TYR 116 Cb 0.15 -0.01 0.03 0.00 -0.31 0.00 0.00 39.34 39.20 3mbg n TYR 116 CO 0.00 0.00 0.00 -0.47 -0.46 0.00 0.00 176.86 175.93 3mbg s TYR 117 N -1.12 2.42 0.56 -0.72 5.04 -0.85 -4.94 117.35 117.74 3mbg s TYR 117 Ca 0.23 1.47 -0.21 0.00 -2.44 0.00 0.00 57.07 56.12 3mbg s TYR 117 Cb 0.14 -3.58 -0.04 0.00 0.35 0.00 0.00 41.96 38.83 3mbg s TYR 117 CO 0.19 -2.35 1.34 -2.14 -1.34 0.00 0.00 175.55 171.25 3mbg s PRO 118 N -3.09 3.08 0.38 4.97 0.02 -1.26 -4.56 135.00 134.54 3mbg s PRO 118 Ca 0.74 2.18 0.12 0.00 0.02 0.00 0.00 61.00 64.05 3mbg s PRO 118 Cb -0.34 -2.20 0.76 0.00 0.02 0.00 0.00 34.50 32.74 3mbg s PRO 118 CO 0.38 -1.22 1.86 -0.44 -0.33 0.00 0.00 177.00 177.26 3mbg h ASP 119 N 1.35 0.08 -2.26 2.53 3.32 -1.94 -1.72 116.42 117.77 3mbg h ASP 119 Ca -0.51 -0.02 -0.59 0.00 0.02 0.00 0.00 57.03 55.93 3mbg h ASP 119 Cb 1.30 -0.02 -0.41 0.00 0.22 0.00 0.00 39.33 40.42 3mbg h ASP 119 CO 0.57 0.37 -0.77 0.18 -1.72 0.00 0.00 179.24 177.87 3mbg n LEU 120 N -4.17 2.30 -4.79 1.55 4.77 -1.26 -4.14 117.00 111.26 3mbg n LEU 120 Ca -0.02 -5.12 -0.35 0.00 -0.03 0.00 0.00 56.01 50.50 3mbg n LEU 120 Cb 0.36 -0.21 -0.02 0.00 -2.33 0.00 0.00 43.42 41.22 3mbg n LEU 120 CO 0.39 2.01 0.75 -2.16 -1.33 0.00 0.00 177.39 177.04 3mbg s PRO 121 N -1.79 3.64 0.75 3.23 0.04 -1.26 -5.02 135.00 134.59 3mbg s PRO 121 Ca 0.36 1.47 -0.13 0.00 0.04 0.00 0.00 61.00 62.75 3mbg s PRO 121 Cb 0.12 -2.08 0.05 0.00 0.04 0.00 0.00 34.50 32.63 3mbg s PRO 121 CO -0.07 -0.59 1.13 0.95 0.04 0.00 0.00 177.00 178.46 3mbg s THR 122 N -1.88 2.85 0.39 1.26 -4.23 -1.26 -4.78 115.64 107.99 3mbg s THR 122 Ca 0.69 0.34 0.20 0.00 -1.18 0.00 0.00 61.69 61.74 3mbg s THR 122 Cb -0.20 -2.78 0.40 0.00 1.34 0.00 0.00 72.50 71.26 3mbg s THR 122 CO 0.23 -0.29 1.71 -0.65 -0.54 0.00 0.00 174.62 175.07 3mbg h PRO 123 N -0.69 0.31 -0.24 3.99 0.11 -1.99 -0.20 132.00 133.29 3mbg h PRO 123 Ca -0.45 -0.02 -0.09 0.00 0.11 0.00 0.00 66.00 65.55 3mbg h PRO 123 Cb 1.26 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 32.29 3mbg h PRO 123 CO 0.50 0.20 -0.20 1.49 -0.21 0.00 0.00 178.00 179.79 3mbg h GLU 124 N 0.31 0.55 -0.69 1.05 4.81 -1.99 -1.67 114.58 116.96 3mbg h GLU 124 Ca 0.69 -0.28 0.04 0.00 -0.13 0.00 0.00 59.36 59.68 3mbg h GLU 124 Cb 1.80 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 31.13 3mbg h GLU 124 CO -0.41 0.86 0.42 1.96 -0.73 0.00 0.00 179.01 181.10 3mbg h GLN 125 N 0.25 0.77 -0.50 1.92 4.20 -1.70 0.19 115.11 120.25 3mbg h GLN 125 Ca 0.04 -0.05 -0.00 0.00 0.06 0.00 0.00 58.65 58.71 3mbg h GLN 125 Cb 0.74 -0.17 -0.02 0.00 0.30 0.00 0.00 27.48 28.32 3mbg h GLN 125 CO 0.05 0.51 0.31 1.96 -0.67 0.00 0.00 178.83 180.99 3mbg h GLN 126 N 0.80 0.67 -0.34 1.46 4.20 -0.92 -0.71 115.11 120.27 3mbg h GLN 126 Ca 0.29 -0.06 -0.05 0.00 0.06 0.00 0.00 58.65 58.89 3mbg h GLN 126 Cb 0.08 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 27.70 3mbg h GLN 126 CO -0.13 0.48 0.01 1.96 -0.67 0.00 0.00 178.83 180.47 3mbg h GLN 127 N 0.67 0.59 -0.74 1.46 4.20 -1.11 -2.66 115.11 117.52 3mbg h GLN 127 Ca 0.18 -0.18 0.00 0.00 0.06 0.00 0.00 58.65 58.71 3mbg h GLN 127 Cb -0.03 -0.06 -0.04 0.00 0.30 0.00 0.00 27.48 27.66 3mbg h GLN 127 CO -0.04 0.71 0.47 -0.44 -0.67 0.00 0.00 178.83 178.86 3mbg h ASP 128 N 0.40 0.87 -0.05 1.46 3.32 -0.41 -1.34 116.42 120.68 3mbg h ASP 128 Ca 0.10 -0.05 -0.18 0.00 0.02 0.00 0.00 57.03 56.92 3mbg h ASP 128 Cb 0.44 -0.22 -0.00 0.00 0.22 0.00 0.00 39.33 39.77 3mbg h ASP 128 CO 0.02 0.66 -0.62 -0.03 -1.72 0.00 0.00 179.24 177.55 3mbg h MET 129 N 1.01 0.66 -0.60 3.56 4.05 -1.12 0.10 114.93 122.59 3mbg h MET 129 Ca 0.27 -0.45 0.01 0.00 -0.28 0.00 0.00 59.70 59.24 3mbg h MET 129 Cb -0.07 0.07 -0.03 0.00 -0.80 0.00 0.00 31.60 30.77 3mbg h MET 129 CO -0.05 1.07 0.40 0.00 0.23 0.00 0.00 176.91 178.56 3mbg h ALA 130 N 0.82 0.76 -0.50 0.39 0.00 -1.32 -2.14 119.26 117.27 3mbg h ALA 130 Ca -0.01 -0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.77 3mbg h ALA 130 Cb 1.20 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.72 3mbg h ALA 130 CO 0.12 0.20 -0.06 0.37 0.00 0.00 0.00 179.25 179.88 3mbg h GLN 131 N 0.81 0.89 -0.42 0.00 5.75 -1.02 -2.15 115.11 118.98 3mbg h GLN 131 Ca 0.22 -0.28 0.04 0.00 -0.15 0.00 0.00 58.65 58.48 3mbg h GLN 131 Cb -0.09 -0.08 -0.04 0.00 1.07 0.00 0.00 27.48 28.34 3mbg h GLN 131 CO -0.05 0.92 0.18 0.35 -2.65 0.00 0.00 178.83 177.59 3mbg h PHE 132 N 0.81 0.33 -0.44 3.99 3.57 -0.40 0.14 116.94 124.94 3mbg h PHE 132 Ca 0.14 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.63 3mbg h PHE 132 Cb 0.57 -0.09 -0.02 0.00 2.79 0.00 0.00 35.95 39.20 3mbg h PHE 132 CO 0.03 0.16 0.16 0.82 -2.23 0.00 0.00 178.31 177.25 3mbg h ILE 133 N 0.37 1.21 -0.41 1.41 1.08 -1.23 -0.79 117.51 119.14 3mbg h ILE 133 Ca 0.18 -0.67 0.03 0.00 -0.39 0.00 0.00 64.86 64.02 3mbg h ILE 133 Cb 0.13 0.83 -0.03 0.00 -3.07 0.00 0.00 36.82 34.67 3mbg h ILE 133 CO -0.15 0.24 0.21 0.45 -0.69 0.00 0.00 178.15 178.21 3mbg h HIS 134 N 0.56 0.39 -0.69 1.37 3.86 -1.08 -1.82 115.15 117.73 3mbg h HIS 134 Ca 0.14 0.02 -0.04 0.00 -1.16 0.00 0.00 60.37 59.33 3mbg h HIS 134 Cb 0.22 -0.11 -0.03 0.00 1.06 0.00 0.00 27.41 28.55 3mbg h HIS 134 CO 0.01 0.20 0.25 -0.07 0.86 0.00 0.00 177.93 179.18 3mbg h LEU 135 N 0.42 0.95 -0.79 2.43 3.38 -0.56 -2.19 115.31 118.96 3mbg h LEU 135 Ca 0.18 -0.15 0.03 0.00 0.09 0.00 0.00 57.88 58.03 3mbg h LEU 135 Cb 0.08 -0.25 -0.05 0.00 0.09 0.00 0.00 40.66 40.53 3mbg h LEU 135 CO -0.12 0.86 0.51 0.15 0.09 0.00 0.00 178.44 179.93 3mbg h PHE 136 N 1.00 0.95 0.00 1.13 3.57 -0.82 -1.84 116.94 120.93 3mbg h PHE 136 Ca 0.23 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.75 3mbg h PHE 136 Cb 0.23 -0.31 -0.00 0.00 2.79 0.00 0.00 35.95 38.65 3mbg h PHE 136 CO 0.02 0.55 -0.03 0.66 -2.23 0.00 0.00 178.31 177.28 3mbg h SER 137 N 0.99 0.00 0.82 0.41 4.64 -0.70 -0.90 113.55 118.81 3mbg h SER 137 Ca 0.32 0.00 -0.24 0.00 -0.47 0.00 0.00 61.79 61.39 3mbg h SER 137 Cb 0.01 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.08 3mbg h SER 137 CO -0.11 0.03 -1.14 0.11 -0.87 0.00 0.00 176.83 174.85 3mbg h LYS 138 N 0.00 0.12 0.00 4.77 1.57 -1.08 -3.40 116.57 118.54 3mbg h LYS 138 Ca -0.00 -0.20 0.00 0.00 -1.87 0.00 0.00 60.65 58.58 3mbg h LYS 138 Cb 0.09 0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.48 3mbg h LYS 138 CO 0.00 1.08 -0.60 1.19 -0.57 0.00 0.00 179.45 180.55 3mbg n PHE 139 N -3.42 0.00 -1.68 -1.35 3.72 -0.96 -4.98 117.46 108.80 3mbg n PHE 139 Ca -0.04 0.00 -0.47 0.00 -0.05 0.00 0.00 57.45 56.88 3mbg n PHE 139 Cb 0.98 -0.03 -0.04 0.00 -0.94 0.00 0.00 39.48 39.44 3mbg n PHE 139 CO 0.00 0.00 0.00 0.98 -0.05 0.00 0.00 176.76 177.69 3mbg n TYR 140 N -1.31 2.36 0.51 1.38 9.36 -0.38 -4.85 117.16 124.23 3mbg n TYR 140 Ca 0.01 -0.07 0.11 0.00 3.32 0.00 0.00 57.90 61.28 3mbg n TYR 140 Cb 0.16 -2.69 0.45 0.00 -0.63 0.00 0.00 39.34 36.63 3mbg n TYR 140 CO 0.00 0.00 0.00 -2.30 0.22 0.00 0.00 176.86 174.78 3mbg n PRO 141 N 6.82 0.15 -2.29 2.98 -0.02 -1.26 -4.42 135.00 136.96 3mbg n PRO 141 Ca 0.22 0.31 -0.41 0.00 -2.02 0.00 0.00 63.50 61.60 3mbg n PRO 141 Cb 0.31 -1.75 -0.03 0.00 -0.02 0.00 0.00 33.50 32.02 3mbg n PRO 141 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3mbg h GLU 143 N 11.85 0.61 -0.65 0.00 5.08 -2.00 0.63 114.58 130.09 3mbg h GLU 143 Ca -0.27 -0.20 0.04 0.00 -1.00 0.00 0.00 59.36 57.93 3mbg h GLU 143 Cb 1.11 -0.05 -0.05 0.00 0.50 0.00 0.00 28.75 30.26 3mbg h GLU 143 CO 1.16 0.73 0.39 1.49 -1.00 0.00 0.00 179.01 181.79 3mbg h GLU 144 N 0.41 0.74 -0.03 2.33 4.81 -1.94 -0.93 114.58 119.97 3mbg h GLU 144 Ca 0.10 -0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 59.28 3mbg h GLU 144 Cb 0.46 -0.17 -0.00 0.00 0.63 0.00 0.00 28.75 29.67 3mbg h GLU 144 CO 0.02 0.49 0.01 0.00 -0.73 0.00 0.00 179.01 178.80 3mbg h ALA 146 N 0.94 0.74 -0.24 0.00 0.00 -0.71 0.13 119.26 120.12 3mbg h ALA 146 Ca 0.01 -0.20 0.03 0.00 0.00 0.00 0.00 54.91 54.75 3mbg h ALA 146 Cb 0.06 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 3mbg h ALA 146 CO -0.00 0.41 0.05 0.93 0.00 0.00 0.00 179.25 180.64 3mbg h GLU 147 N 0.79 0.14 -0.29 0.00 5.08 -1.13 0.23 114.58 119.40 3mbg h GLU 147 Ca 0.18 -0.01 0.06 0.00 -1.00 0.00 0.00 59.36 58.59 3mbg h GLU 147 Cb 0.30 -0.03 -0.06 0.00 0.50 0.00 0.00 28.75 29.46 3mbg h GLU 147 CO -0.00 0.09 -0.08 0.22 -1.00 0.00 0.00 179.01 178.24 3mbg h ASP 148 N 0.14 -0.28 -0.43 1.42 1.82 -1.02 -2.28 116.42 115.79 3mbg h ASP 148 Ca 0.11 0.09 -0.01 0.00 -0.39 0.00 0.00 57.03 56.83 3mbg h ASP 148 Cb 0.11 0.18 -0.02 0.00 0.68 0.00 0.00 39.33 40.28 3mbg h ASP 148 CO -0.15 -0.10 0.22 0.25 -1.61 0.00 0.00 179.24 177.86 3mbg h LEU 149 N -0.00 0.55 -1.30 2.28 5.85 -0.55 -1.79 115.31 120.34 3mbg h LEU 149 Ca 0.14 -0.11 -0.02 0.00 0.84 0.00 0.00 57.88 58.74 3mbg h LEU 149 Cb 0.22 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.08 3mbg h LEU 149 CO -0.30 0.50 0.26 0.03 -0.34 0.00 0.00 178.44 178.59 3mbg h ARG 150 N 0.56 0.74 -0.41 1.25 3.08 -0.80 0.40 114.38 119.21 3mbg h ARG 150 Ca 0.15 -0.09 -0.09 0.00 0.07 0.00 0.00 59.98 60.02 3mbg h ARG 150 Cb 0.08 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 29.97 3mbg h ARG 150 CO -0.02 0.57 -0.10 0.87 -1.07 0.00 0.00 179.97 180.22 3mbg h LYS 151 N 0.75 0.79 -0.01 0.04 1.57 -1.13 -0.99 116.57 117.59 3mbg h LYS 151 Ca 0.19 -0.30 -0.00 0.00 -1.87 0.00 0.00 60.65 58.66 3mbg h LYS 151 Cb 0.07 -0.04 -0.00 0.00 0.08 0.00 0.00 32.23 32.33 3mbg h LYS 151 CO -0.03 0.92 0.00 0.00 -0.57 0.00 0.00 179.45 179.77 3mbg h ARG 152 N 0.60 0.01 0.00 3.15 3.08 -0.76 -2.94 114.38 117.53 3mbg h ARG 152 Ca 0.10 -0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.13 3mbg h ARG 152 Cb 0.63 -0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.68 3mbg h ARG 152 CO 0.04 0.16 -0.08 -0.07 -1.07 0.00 0.00 179.97 178.96 3mbg h LEU 153 N -0.14 0.00 -1.52 3.04 3.38 -0.87 0.67 115.31 119.87 3mbg h LEU 153 Ca 0.00 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 3mbg h LEU 153 Cb 0.15 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 3mbg h LEU 153 CO -0.00 0.08 -0.00 0.00 0.09 0.00 0.00 178.44 178.60 3mbg h ALA 154 N 1.92 1.62 0.00 1.53 0.00 -0.98 -3.26 119.26 120.09 3mbg h ALA 154 Ca -0.00 -0.13 -0.42 0.00 0.00 0.00 0.00 54.91 54.36 3mbg h ALA 154 Cb 0.32 -0.10 -0.07 0.00 0.00 0.00 0.00 17.79 17.94 3mbg h ALA 154 CO 0.01 0.29 -2.48 -2.13 0.00 0.00 0.00 179.25 174.93 3mbg n ARG 155 N -4.36 0.61 -3.28 0.00 0.63 -0.92 -4.82 116.66 104.52 3mbg n ARG 155 Ca 0.00 0.19 -0.46 0.00 -0.92 0.00 0.00 57.85 56.66 3mbg n ARG 155 Cb 0.19 -1.49 -0.02 0.00 0.45 0.00 0.00 32.46 31.59 3mbg n ARG 155 CO 0.00 0.00 0.00 1.21 -2.51 0.00 0.00 177.63 176.33 3mbg s ASN 156 N -6.89 6.79 0.44 6.15 2.47 0.18 -5.04 114.94 119.05 3mbg s ASN 156 Ca -0.36 -2.68 -0.22 0.00 0.42 0.00 0.00 52.86 50.02 3mbg s ASN 156 Cb 0.11 -2.24 -0.09 0.00 -1.45 0.00 0.00 41.25 37.59 3mbg s ASN 156 CO 0.54 -0.61 1.04 -1.00 -3.72 0.00 0.00 177.10 173.35 3mbg s HIS 157 N 0.38 3.14 0.23 0.43 3.76 -1.24 -4.21 115.29 117.78 3mbg s HIS 157 Ca 0.21 1.61 -0.31 0.00 -0.15 0.00 0.00 55.06 56.42 3mbg s HIS 157 Cb -0.09 -3.09 -0.13 0.00 1.11 0.00 0.00 32.58 30.38 3mbg s HIS 157 CO -0.09 -0.69 1.43 -2.30 -0.85 0.00 0.00 174.74 172.24 3mbg n PRO 158 N -0.51 2.06 -3.20 8.40 -0.02 -1.26 -4.93 135.00 135.54 3mbg n PRO 158 Ca 0.07 0.74 -0.44 0.00 -2.02 0.00 0.00 63.50 61.85 3mbg n PRO 158 Cb 0.51 -2.41 -0.07 0.00 -0.02 0.00 0.00 33.50 31.52 3mbg n PRO 158 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 3mbg s ASP 159 N 0.37 6.22 -0.16 2.55 -1.08 -1.26 -4.88 116.67 118.42 3mbg s ASP 159 Ca 0.69 -0.90 0.17 0.00 -0.52 0.00 0.00 52.55 51.99 3mbg s ASP 159 Cb -0.65 -2.27 0.45 0.00 -1.46 0.00 0.00 42.92 38.99 3mbg s ASP 159 CO 0.48 -0.82 1.34 0.35 0.52 0.00 0.00 175.17 177.04 3mbg n THR 160 N 5.56 2.13 -0.30 1.71 -2.24 -1.26 -3.15 114.28 116.72 3mbg n THR 160 Ca -0.07 -1.95 -0.05 0.00 -2.27 0.00 0.00 64.05 59.71 3mbg n THR 160 Cb 0.46 -0.22 0.07 0.00 -2.10 0.00 0.00 70.33 68.54 3mbg n THR 160 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 3mbg h ARG 161 N 1.31 1.19 -4.18 -0.78 2.43 -1.92 -3.43 114.38 109.01 3mbg h ARG 161 Ca 0.00 -0.18 -0.15 0.00 -0.81 0.00 0.00 59.98 58.83 3mbg h ARG 161 Cb 1.29 -0.21 -0.13 0.00 -0.42 0.00 0.00 29.97 30.50 3mbg h ARG 161 CO 0.15 0.93 -0.47 0.95 -1.51 0.00 0.00 179.97 180.02 3mbg s THR 162 N -5.67 0.06 0.22 0.20 -4.23 -1.26 -4.45 115.64 100.51 3mbg s THR 162 Ca -0.13 -1.68 -0.09 0.00 -1.18 0.00 0.00 61.69 58.60 3mbg s THR 162 Cb 0.16 -2.07 0.19 0.00 1.34 0.00 0.00 72.50 72.12 3mbg s THR 162 CO 0.83 -0.27 1.68 -0.09 -0.54 0.00 0.00 174.62 176.23 3mbg h ARG 163 N 2.64 0.18 -0.40 3.99 2.43 -1.46 0.24 114.38 122.00 3mbg h ARG 163 Ca -0.33 -0.01 0.01 0.00 -0.81 0.00 0.00 59.98 58.83 3mbg h ARG 163 Cb 1.22 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.71 3mbg h ARG 163 CO 0.52 0.12 0.26 0.00 -1.51 0.00 0.00 179.97 179.36 3mbg h ALA 164 N 1.54 0.51 -0.41 2.80 0.00 -1.89 -0.91 119.26 120.89 3mbg h ALA 164 Ca 0.33 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 55.18 3mbg h ALA 164 Cb 0.54 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 3mbg h ALA 164 CO -0.48 -0.05 0.08 0.00 0.00 0.00 0.00 179.25 178.80 3mbg h ALA 165 N 1.15 0.55 -0.10 0.00 0.00 -1.79 -2.64 119.26 116.42 3mbg h ALA 165 Ca 0.15 -0.21 -0.05 0.00 0.00 0.00 0.00 54.91 54.80 3mbg h ALA 165 Cb -0.05 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.58 3mbg h ALA 165 CO -0.04 0.25 -0.13 0.35 0.00 0.00 0.00 179.25 179.68 3mbg h PHE 166 N 0.53 0.33 -0.82 0.00 3.57 -0.70 0.14 116.94 119.98 3mbg h PHE 166 Ca 0.13 -0.10 0.10 0.00 3.53 0.00 0.00 57.97 61.62 3mbg h PHE 166 Cb 0.35 -0.07 -0.08 0.00 2.79 0.00 0.00 35.95 38.95 3mbg h PHE 166 CO 0.02 0.71 0.46 1.79 -2.23 0.00 0.00 178.31 179.06 3mbg h THR 167 N -0.15 0.88 -0.16 4.41 1.35 -1.24 0.56 112.91 118.56 3mbg h THR 167 Ca 0.01 -0.26 -0.02 0.00 -0.55 0.00 0.00 66.41 65.59 3mbg h THR 167 Cb 0.66 0.06 -0.01 0.00 -1.73 0.00 0.00 68.15 67.14 3mbg h THR 167 CO 0.03 0.14 0.02 1.56 -0.25 0.00 0.00 175.52 177.01 3mbg h GLN 168 N 0.76 0.27 -0.29 4.72 1.08 -1.38 -1.62 115.11 118.64 3mbg h GLN 168 Ca 0.40 -0.08 0.06 0.00 -1.45 0.00 0.00 58.65 57.58 3mbg h GLN 168 Cb 0.40 -0.03 -0.06 0.00 -0.05 0.00 0.00 27.48 27.74 3mbg h GLN 168 CO -0.26 0.46 -0.08 2.35 -0.95 0.00 0.00 178.83 180.35 3mbg h TRP 169 N 0.03 -0.18 -0.22 2.96 7.01 -0.27 -1.21 115.95 124.07 3mbg h TRP 169 Ca 0.05 0.03 -0.13 0.00 2.11 0.00 0.00 58.89 60.94 3mbg h TRP 169 Cb 0.33 0.13 -0.01 0.00 -2.10 0.00 0.00 29.16 27.51 3mbg h TRP 169 CO 0.02 -0.14 -0.43 1.25 -2.79 0.00 0.00 178.44 176.36 3mbg h LEU 170 N -0.02 0.56 -0.68 0.65 5.85 -0.93 -1.12 115.31 119.62 3mbg h LEU 170 Ca 0.14 -0.26 -0.03 0.00 0.84 0.00 0.00 57.88 58.58 3mbg h LEU 170 Cb 0.23 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.07 3mbg h LEU 170 CO -0.31 0.92 0.32 0.00 -0.34 0.00 0.00 178.44 179.03 3mbg h HIS 172 N 0.95 0.45 -0.46 0.00 -0.00 -0.97 -1.43 115.15 113.69 3mbg h HIS 172 Ca 0.23 -0.03 0.09 0.00 -0.00 0.00 0.00 60.37 60.66 3mbg h HIS 172 Cb 0.13 -0.13 -0.08 0.00 -0.00 0.00 0.00 27.41 27.33 3mbg h HIS 172 CO 0.01 0.44 -0.03 1.25 -0.00 0.00 0.00 177.93 179.60 3mbg h LEU 173 N 0.33 -0.26 -0.90 0.26 5.85 -0.99 -0.97 115.31 118.63 3mbg h LEU 173 Ca 0.10 0.12 0.02 0.00 0.84 0.00 0.00 57.88 58.95 3mbg h LEU 173 Cb 0.18 0.22 -0.05 0.00 0.37 0.00 0.00 40.66 41.38 3mbg h LEU 173 CO -0.01 -0.09 0.59 -0.74 -0.34 0.00 0.00 178.44 177.85 3mbg h HIS 174 N 0.08 1.11 -0.58 1.25 2.76 -1.05 -2.34 115.15 116.38 3mbg h HIS 174 Ca 0.23 0.03 -0.04 0.00 -2.20 0.00 0.00 60.37 58.39 3mbg h HIS 174 Cb 0.34 -0.37 -0.03 0.00 1.55 0.00 0.00 27.41 28.90 3mbg h HIS 174 CO -0.32 0.68 0.21 -0.91 -1.30 0.00 0.00 177.93 176.28 3mbg h ASN 175 N 1.18 0.78 -0.80 3.26 -0.26 -0.37 0.51 115.58 119.88 3mbg h ASN 175 Ca 0.34 -0.11 0.06 0.00 -0.56 0.00 0.00 56.30 56.03 3mbg h ASN 175 Cb -0.08 -0.20 -0.06 0.00 -1.06 0.00 0.00 38.32 36.92 3mbg h ASN 175 CO -0.09 0.72 0.49 -0.33 -1.06 0.00 0.00 177.43 177.15 3mbg h GLU 176 N 0.83 0.87 -0.33 0.81 5.08 -0.67 -0.52 114.58 120.65 3mbg h GLU 176 Ca 0.19 -0.05 -0.07 0.00 -1.00 0.00 0.00 59.36 58.43 3mbg h GLU 176 Cb 0.20 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 3mbg h GLU 176 CO -0.01 0.58 -0.06 0.28 -1.00 0.00 0.00 179.01 178.80 3mbg h VAL 177 N 0.90 1.27 -0.74 3.13 2.07 -1.09 -2.54 116.25 119.25 3mbg h VAL 177 Ca 0.34 -1.09 0.14 0.00 0.82 0.00 0.00 66.70 66.92 3mbg h VAL 177 Cb 0.15 1.31 -0.10 0.00 -1.52 0.00 0.00 31.29 31.13 3mbg h VAL 177 CO -0.16 0.35 0.27 0.78 0.02 0.00 0.00 177.57 178.83 3mbg h ASN 178 N 0.41 0.23 -0.46 0.57 2.35 -0.49 -1.95 115.58 116.23 3mbg h ASN 178 Ca 0.09 0.11 -0.07 0.00 -0.55 0.00 0.00 56.30 55.88 3mbg h ASN 178 Cb 0.54 0.10 -0.02 0.00 0.05 0.00 0.00 38.32 39.00 3mbg h ASN 178 CO 0.03 0.08 0.03 0.03 -1.65 0.00 0.00 177.43 175.95 3mbg h ARG 179 N 0.41 0.79 -0.77 0.81 3.08 -0.95 0.40 114.38 118.15 3mbg h ARG 179 Ca 0.40 -0.24 0.06 0.00 0.07 0.00 0.00 59.98 60.27 3mbg h ARG 179 Cb 0.62 -0.08 -0.05 0.00 0.08 0.00 0.00 29.97 30.54 3mbg h ARG 179 CO -0.41 0.83 0.50 -0.22 -1.07 0.00 0.00 179.97 179.60 3mbg h LYS 180 N 0.65 0.83 -0.46 0.04 3.64 -1.08 -2.50 116.57 117.69 3mbg h LYS 180 Ca 0.13 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.46 3mbg h LYS 180 Cb 0.45 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.08 3mbg h LYS 180 CO 0.02 0.55 0.00 1.28 -2.27 0.00 0.00 179.45 179.02 3mbg n LEU 181 N -4.47 2.82 -1.05 5.20 4.77 -0.77 -4.93 117.00 118.57 3mbg n LEU 181 Ca 0.11 -1.34 -0.10 0.00 -0.03 0.00 0.00 56.01 54.65 3mbg n LEU 181 Cb 0.19 -0.30 -0.01 0.00 -2.33 0.00 0.00 43.42 40.97 3mbg n LEU 181 CO 0.34 0.67 -0.12 0.61 -1.33 0.00 0.00 177.39 177.56 3mbg n GLY 182 N 1.36 0.16 3.91 -0.72 0.00 -0.70 -5.04 105.19 104.16 3mbg n GLY 182 Ca 0.18 -0.50 -0.30 0.00 0.00 0.00 0.00 46.02 45.41 3mbg n GLY 182 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3mbg s LYS 183 N -4.21 3.56 0.72 1.61 1.02 0.13 -5.01 119.74 117.57 3mbg s LYS 183 Ca 0.00 -0.23 -0.13 0.00 0.02 0.00 0.00 55.97 55.64 3mbg s LYS 183 Cb 0.00 -2.85 0.03 0.00 -0.52 0.00 0.00 37.83 34.49 3mbg s LYS 183 CO 0.00 0.44 1.10 -1.25 -0.92 0.00 0.00 175.35 174.72 3mbg s PRO 184 N -2.97 2.47 0.32 -1.68 0.04 -1.26 -4.03 135.00 127.89 3mbg s PRO 184 Ca 0.39 1.29 -0.29 0.00 0.04 0.00 0.00 61.00 62.44 3mbg s PRO 184 Cb -0.12 -1.92 -0.10 0.00 0.04 0.00 0.00 34.50 32.41 3mbg s PRO 184 CO 0.27 -1.49 1.29 -0.51 0.04 0.00 0.00 177.00 176.60 3mbg s ASP 185 N -2.98 6.81 0.17 6.66 1.11 -1.26 -4.85 116.67 122.32 3mbg s ASP 185 Ca 0.64 2.65 -0.28 0.00 0.18 0.00 0.00 52.55 55.74 3mbg s ASP 185 Cb -0.19 -2.65 -0.08 0.00 1.07 0.00 0.00 42.92 41.08 3mbg s ASP 185 CO 0.49 -0.51 0.87 0.12 1.18 0.00 0.00 175.17 177.33 3mbg s PHE 186 N -1.07 3.90 -0.51 4.23 5.36 -1.26 -5.01 117.98 123.61 3mbg s PHE 186 Ca 0.49 1.75 -0.28 0.00 -0.96 0.00 0.00 56.93 57.93 3mbg s PHE 186 Cb -0.39 -2.91 0.01 0.00 -0.34 0.00 0.00 43.02 39.39 3mbg s PHE 186 CO 0.51 0.41 1.50 0.34 -1.46 0.00 0.00 175.22 176.52 3mbg s ASP 187 N -0.80 6.05 0.56 6.13 -1.08 -1.26 -4.86 116.67 121.41 3mbg s ASP 187 Ca 0.40 0.51 0.36 0.00 -0.52 0.00 0.00 52.55 53.30 3mbg s ASP 187 Cb -0.24 -2.54 1.61 0.00 -1.46 0.00 0.00 42.92 40.29 3mbg s ASP 187 CO 0.29 -1.72 2.06 0.00 0.52 0.00 0.00 175.17 176.31 3mbg n SER 189 N -3.02 0.61 -1.41 0.00 3.41 -1.26 -2.37 113.62 109.59 3mbg n SER 189 Ca -0.00 0.71 0.10 0.00 -0.26 0.00 0.00 58.87 59.42 3mbg n SER 189 Cb 0.24 -0.82 0.33 0.00 -0.26 0.00 0.00 64.21 63.70 3mbg n SER 189 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3mbg n LYS 190 N -2.24 3.23 -0.27 4.33 4.76 -0.18 -4.67 118.16 123.12 3mbg n LYS 190 Ca 0.00 -2.74 -0.04 0.00 -2.87 0.00 0.00 58.31 52.67 3mbg n LYS 190 Cb 0.13 -1.71 0.12 0.00 -1.84 0.00 0.00 35.03 31.74 3mbg n LYS 190 CO 0.00 0.00 0.00 -0.39 -1.37 0.00 0.00 177.40 175.64 3mbg h VAL 191 N 3.99 1.25 -0.50 -0.18 -1.51 -1.61 -1.54 116.25 116.14 3mbg h VAL 191 Ca 0.00 -0.70 -0.12 0.00 -1.23 0.00 0.00 66.70 64.66 3mbg h VAL 191 Cb 1.20 0.25 -0.02 0.00 -2.13 0.00 0.00 31.29 30.60 3mbg h VAL 191 CO 0.11 0.30 -0.15 0.44 -1.23 0.00 0.00 177.57 177.04 3mbg h ASP 192 N 1.11 0.98 -0.42 4.19 3.32 -1.85 -0.65 116.42 123.11 3mbg h ASP 192 Ca 0.27 -0.34 0.05 0.00 0.02 0.00 0.00 57.03 57.02 3mbg h ASP 192 Cb 0.12 -0.27 -0.04 0.00 0.22 0.00 0.00 39.33 39.36 3mbg h ASP 192 CO -0.03 1.12 0.17 -0.33 -1.72 0.00 0.00 179.24 178.45 3mbg h GLU 193 N 0.86 0.34 -0.37 3.56 5.08 -1.69 0.42 114.58 122.78 3mbg h GLU 193 Ca 0.13 -0.02 -0.14 0.00 -1.00 0.00 0.00 59.36 58.33 3mbg h GLU 193 Cb 0.71 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.88 3mbg h GLU 193 CO 0.05 0.22 -0.31 -0.09 -1.00 0.00 0.00 179.01 177.89 3mbg h ARG 194 N 0.35 0.87 -0.01 2.33 9.65 -1.12 0.29 114.38 126.75 3mbg h ARG 194 Ca 0.19 -0.44 0.00 0.00 -1.10 0.00 0.00 59.98 58.63 3mbg h ARG 194 Cb 0.15 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.73 3mbg h ARG 194 CO -0.17 1.08 -0.02 0.91 2.80 0.00 0.00 179.97 184.57 3mbg n TRP 195 N -4.14 0.00 0.11 2.20 7.02 -0.27 -4.79 117.44 117.57 3mbg n TRP 195 Ca -0.02 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.46 3mbg n TRP 195 Cb 0.50 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.39 3mbg n TRP 195 CO 0.00 0.00 0.00 -2.13 -2.02 0.00 0.00 177.69 173.54 3mbg n ARG 196 N 0.12 0.00 -0.00 -0.99 0.63 0.14 -4.79 116.66 111.76 3mbg n ARG 196 Ca 0.03 0.00 -0.01 0.00 -0.92 0.00 0.00 57.85 56.94 3mbg n ARG 196 Cb 0.12 -0.04 -0.11 0.00 0.45 0.00 0.00 32.46 32.87 3mbg n ARG 196 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 3mbg n ASP 197 N -3.30 0.60 0.00 6.15 8.00 0.13 -5.01 116.55 123.12 3mbg n ASP 197 Ca 0.00 0.27 0.00 0.00 0.71 0.00 0.00 54.79 55.77 3mbg n ASP 197 Cb 0.01 0.52 0.00 0.00 -0.02 0.00 0.00 41.12 41.63 3mbg n ASP 197 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3mbg n GLY 198 N 1.46 -0.34 3.75 0.44 0.00 0.09 -4.91 105.19 105.67 3mbg n GLY 198 Ca -0.14 -1.64 -0.39 0.00 0.00 0.00 0.00 46.02 43.85 3mbg n GLY 198 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 3mbg n TRP 199 N -0.07 2.47 -0.34 1.61 7.02 -1.24 -4.49 117.44 122.40 3mbg n TRP 199 Ca 0.00 0.44 0.19 0.00 -1.02 0.00 0.00 57.50 57.11 3mbg n TRP 199 Cb 0.00 -2.41 0.42 0.00 -2.42 0.00 0.00 31.31 26.90 3mbg n TRP 199 CO 0.00 0.00 0.00 0.87 -2.02 0.00 0.00 177.69 176.54 3mbg h LYS 200 N 1.89 0.51 0.00 -0.99 1.79 -1.93 -0.79 116.57 117.04 3mbg h LYS 200 Ca -0.51 -0.03 0.00 0.00 -2.18 0.00 0.00 60.65 57.93 3mbg h LYS 200 Cb 1.29 -0.11 0.00 0.00 -1.58 0.00 0.00 32.23 31.82 3mbg h LYS 200 CO 0.59 0.33 0.00 -0.40 -1.08 0.00 0.00 179.45 178.90 3mbg n ASP 201 N -4.81 0.00 0.00 0.86 5.75 -1.26 -4.85 116.55 112.24 3mbg n ASP 201 Ca 0.27 0.39 0.00 0.00 -0.01 0.00 0.00 54.79 55.43 3mbg n ASP 201 Cb 0.79 -0.44 0.00 0.00 -1.03 0.00 0.00 41.12 40.45 3mbg n ASP 201 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3mbg n GLY 202 N -0.31 0.60 0.02 6.12 0.00 -0.30 -4.93 105.19 106.38 3mbg n GLY 202 Ca 0.04 -0.02 0.06 0.00 0.00 0.00 0.00 46.02 46.10 3mbg n GLY 202 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3mbg n SER 203 N 0.03 0.09 -0.02 1.61 3.41 -1.26 -1.42 113.62 116.05 3mbg n SER 203 Ca 0.00 0.53 0.06 0.00 -0.26 0.00 0.00 58.87 59.20 3mbg n SER 203 Cb 0.00 -0.54 -0.15 0.00 -0.26 0.00 0.00 64.21 63.26 3mbg n SER 203 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88